N-(3-azanyl-4-methoxy-phenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-azanyl-4-methoxy-phenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-amino-4-methoxy-phenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(3-amino-4-methoxyphenyl)-2-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-amino-4-methoxyphenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-amino-4-methoxy-phenyl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]acetamide Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC(=O)NC2=CC(=C(C=C2)OC)N)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CC(=O)NC2=CC(=C(C=C2)OC)N)C

InChI

InChI=1S/C16H25N3O2/c1-11-6-12(2)9-19(8-11)10-16(20)18-13-4-5-15(21-3)14(17)7-13/h4-5,7,11-12H,6,8-10,17H2,1-3H3,(H,18,20)/p+1/t11-,12-/m0/s1